Caaattgttctgctgttg

Structural Information

Molecular Formula

C₁₇₇H₂₂₆N₆₀O₁₁₄P₁₈

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C177H226N60O114P18/c1-69-33-223(170(254)212-151(69)239)120-19-81(338-353(265,266)300-41-95-77(238)15-116(317-95)234-65-197-137-147(234)204-163(184)208-159(137)247)99(321-120)45-305-358(275,276)340-84-22-123(226-36-72(4)154(242)215-173(226)257)327-105(84)51-309-366(291,292)350-93-31-132(236-67-199-139-149(236)206-165(186)210-161(139)249)333-111(93)57-315-362(283,284)344-87-25-126(229-39-75(7)157(245)218-176(229)260)323-101(87)47-304-356(271,272)337-80-18-119(222-14-11-115(180)203-169(222)253)320-98(80)44-302-364(287,288)349-92-30-131(235-66-198-138-148(235)205-164(185)209-160(138)248)332-110(92)56-314-361(281,282)343-86-24-125(228-38-74(6)156(244)217-175(228)259)322-100(86)46-303-355(269,270)336-79-17-118(221-13-10-114(179)202-168(221)252)319-97(79)43-301-357(273,274)339-82-20-121(224-34-70(2)152(240)213-171(224)255)324-102(82)48-306-359(277,278)342-85-23-124(227-37-73(5)155(243)216-174(227)258)328-106(85)52-310-367(293,294)351-94-32-133(237-68-200-140-150(237)207-166(187)211-162(140)250)334-112(94)58-316-363(285,286)345-88-26-127(230-40-76(8)158(246)219-177(230)261)325-103(88)49-307-360(279,280)341-83-21-122(225-35-71(3)153(241)214-172(225)256)326-104(83)50-308-365(289,290)346-89-27-128(231-62-194-134-141(181)188-59-191-144(134)231)330-108(89)54-312-369(297,298)348-91-29-130(233-64-196-136-143(183)190-61-193-146(136)233)331-109(91)55-313-368(295,296)347-90-28-129(232-63-195-135-142(182)189-60-192-145(135)232)329-107(90)53-311-354(267,268)335-78-16-117(220-12-9-113(178)201-167(220)251)318-96(78)42-299-352(262,263)264/h9-14,33-40,59-68,77-112,116-133,238H,15-32,41-58H2,1-8H3,(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H,293,294)(H,295,296)(H,297,298)(H2,178,201,251)(H2,179,202,252)(H2,180,203,253)(H2,181,188,191)(H2,182,189,192)(H2,183,190,193)(H,212,239,254)(H,213,240,255)(H,214,241,256)(H,215,242,257)(H,216,243,258)(H,217,244,259)(H,218,245,260)(H,219,246,261)(H2,262,263,264)(H3,184,204,208,247)(H3,185,205,209,248)(H3,186,206,210,249)(H3,187,207,211,250)

InChIKey

NKXYEDWSJBRWHP-UHFFFAOYSA-N

Compound name

[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl [5-(4-amino-2-oxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16197297